tri(propan-2-yloxy)-propylsilane

C12H28O3Si — CID 21479776

IUPACtri(propan-2-yloxy)-propylsilane
SMILESCCC[Si](OC(C)C)(OC(C)C)OC(C)C
InChIInChI=1S/C12H28O3Si/c1-8-9-16(13-10(2)3,14-11(4)5)15-12(6)7/h10-12H,8-9H2,1-7H3
InChIKeyMQVCTPXBBSKLFS-UHFFFAOYSA-N
MW248.44 g/mol
LogP3.61
Rot. Bonds8

About tri(propan-2-yloxy)-propylsilane

tri(propan-2-yloxy)-propylsilane (PubChem CID 21479776) has the molecular formula C12H28O3Si and a molecular weight of 248.44 g/mol. Its IUPAC name is tri(propan-2-yloxy)-propylsilane.

Molecular Properties

Compound Nametri(propan-2-yloxy)-propylsilane
PubChem CID21479776
Molecular FormulaC12H28O3Si
Molecular Weight248.44 g/mol
Exact Mass248.18
IUPAC Nametri(propan-2-yloxy)-propylsilane
SMILESCCC[Si](OC(C)C)(OC(C)C)OC(C)C
InChIInChI=1S/C12H28O3Si/c1-8-9-16(13-10(2)3,14-11(4)5)15-12(6)7/h10-12H,8-9H2,1-7H3
InChIKeyMQVCTPXBBSKLFS-UHFFFAOYSA-N
XLogP3.61
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.44
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tri(propan-2-yloxy)-propylsilane?
The IUPAC name of tri(propan-2-yloxy)-propylsilane (CID 21479776) is tri(propan-2-yloxy)-propylsilane.
What is the SMILES notation for tri(propan-2-yloxy)-propylsilane?
The canonical SMILES for tri(propan-2-yloxy)-propylsilane is CCC[Si](OC(C)C)(OC(C)C)OC(C)C.
What is the InChIKey of tri(propan-2-yloxy)-propylsilane?
The InChIKey is MQVCTPXBBSKLFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28O3Si/c1-8-9-16(13-10(2)3,14-11(4)5)15-12(6)7/h10-12H,8-9H2,1-7H3.
What are the key properties of tri(propan-2-yloxy)-propylsilane?
tri(propan-2-yloxy)-propylsilane has a molecular weight of 248.44 g/mol, XLogP of 3.61, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tri(propan-2-yloxy)-propylsilane is sourced from PubChem (CID 21479776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).